Vitas-M small molecule compound
3-(4-methoxyphenyl)-2-[(3-methylbenzyl)sulfanyl]-3H-spiro[benzo[h]quinazoline-5,1'-cyclohexan]-4(6H)-one
Catalog ID
STK551832
SMILES COc1ccc(cc1)n1c(SCc2cccc(c2)C)nc2c(c1=O)C1(CCCCC1)Cc1c2cccc1
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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.
We do not supply quantities above 5 g.
Structure and other identifiers
2D representation rendered from the SMILES, with core physicochemical data.Formula C32H32N2O2S MW 508.68 g/mol Purity >90% as per NMR
InChI
InChI=1S/C32H32N2O2S/c1-22-9-8-10-23(19-22)21-37-31-33-29-27-12-5-4-11-24(27)20-32(17-6-3-7-18-32)28(29)30(35)34(31)25-13-15-26(36-2)16-14-25/h4-5,8-16,19H,3,6-7,17-18,20-21H2,1-2H3InChIKey
NCUDLZDGVCZXSL-UHFFFAOYSA-NSynonyms
799807-96-83(4methoxyphenyl)2((3methylbenzyl)sulfanyl)3Hspiro(benzo(h)quinazoline51cyclohexan)4(6H)one
3(4methoxyphenyl)2((3methylbenzyl)thio)3Hspiro(benzo(h)quinazoline51cyclohexan)4(6H)one
3(4METHOXYPHENYL)2((3METHYLPHENYL)METHYLSULFANYL)SPIRO(6HBENZO(H)QUINAZOLINE51CYCLOHEXANE)4ONE
799807968
CC1=CC(=CC=C1)CSC2=NC3=C(C(=O)N2C4=CC=C(C=C4)OC)C5(CCCCC5)CC6=CC=CC=C63
InChI=1SC32H32N2O2Sc122981023(1922)21373133292712541124(27)2032(176371832)28(29)30(35)34(31)25131526(362)161425h4581619H36717182021H212H3
MFCD03679643
ZINC000002228819
ZINC02228819
ZINC2228819
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